Version2.4 2021-05-25T20:08:31Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 26-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCN(CC)S(=O)(=O)c1ccc(c(c1)C(=O)[O-])N2CCN(CC2)Cc3ccc(cc3)C#N C13091639 RHF 6-31G(d) (6D,7F) CCN(CC)S(=O)(=O)c1ccc(c(c1)C(=O)[O-])N2CCN(CC2)Cc3ccc(cc3)C#N C01[X(C23H27N4O4S1)] 171 C1 538 CCN(S(=O)(=O)c1ccc(c(c1)C(=O)[O-])N1CCN(CC1)Cc1ccc(cc1)C#N)CC CCN(S(=O)(=O)c1ccc(c(c1)C(=O)[O-])N1CCN(CC1)Cc1ccc(cc1)C#N)CC CCN(CC)[S](=O)(=O)c1ccc(N2CCN(CC2)Cc3ccc(cc3)C#N)c(c1)C([O-])=O InChIKey=UTJCKFIAGDFFQB-UHFFFAOYSA-M InChI=1S/C23H28N4O4S/c1-3-27(4-2)32(30,31)20-9-10-22(21(15-20)23(28)29)26-13-11-25(12-14-26)17-19-7-5-18(16-24)6-8-19/h5-10,15H,3-4,11-14,17H2,1-2H3,(H,28,29)/p-1 InChI=1/C23H28N4O4S/c1-3-27(4-2)32(30,31)20-9-10-22(21(15-20)23(28)29)26-13-11-25(12-14-26)17-19-7-5-18(16-24)6-8-19/h5-10,15H,3-4,11-14,17H2,1-2H3,(H,28,29)/p-1/fC23H27N4O4S/q-1 CCN(CC)S(=O)(=O)c1ccc(c(c1)C(=O)[O-])N2CCN(CC2)Cc3ccc(cc3)C#N C01[X(C23H27N4O4S1)] 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0.3790 0.8053 0.7034 0.8501 0.8567 0.4038 0.6864 0.5113 0.8192 0.8553 0.8559 0.4208 0.6380 0.8531 0.3969 0.2507 0.8479 0.1586 0.5351 0.2552 0.8523 0.2584 0.2553 0.5296 0.1731 0.2123 0.7677 0.0171 0.6793 0.7422 0.8149 0.8535 0.7620 0.7731 0.6555 0.8206 0.8474 0.7118 0.7834 0.6026 0.5365 0.5751 0.8107 0.5484 0.8192 0.8389 0.6762 0.0595 0.6194 0.6693 0.8357 0.7164 0.8477 0.2516 0.2722 0.8326 0.2716 0.7097 0.8524 0.5264 0.8196 0.8481 0.8425 0.8539 0.7835 0.3217 0.4352 0.5583 0.7260 0.8178 0.8571 0.8288 0.7750 0.6643 0.4032 0.7351 0.7567 0.8327 0.8519 0.5840 0.7301 0.8295 0.6078 0.8255 0.8434 0.7353 0.5776 0.8104 0.8371 0.7075 0.6808 0.8415 0.8252 0.8509 0.7121 0.6661 0.3687 0.7828 0.8245 0.4960 0.2814 0.8197 0.6905 0.6218 0.7549 0.4809 0.5488 0.4018 0.2158 0.2656 0.1711 0.2315 0.8407 0.2085 0.3194 0.7157 0.4838 0.3983 0.8546 0.6652 0.4361 0.8314 0.8471 0.8085 0.4366 0.7321 0.5774 0.4247 0.7021 0.3436 0.2953 0.2849 0.3635 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 6 6 7 6 6 16 8 8 6 6 6 6 6 6 6 8 8 7 6 6 7 6 6 6 6 6 6 6 6 6 6 7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 14.00307 12.00000 12.00000 31.97207 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 15.99491 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 6017.7915 43043.8496 45693.6557 0.99993 0.00886 0.00774 -0.00897 0.99987 0.01316 -0.00762 -0.01323 0.99988 1 0.01439 0.00201 0.00190 0.29990 0.04193 0.03950 20.28 29.51 35.85 45.41 49.72 62.82 72.30 93.93 98.91 120.88 133.77 159.66 184.78 190.95 216.26 224.90 233.29 265.14 311.57 325.48 339.51 347.19 371.71 400.35 443.29 446.93 458.57 468.59 498.86 500.69 513.66 552.90 559.59 598.33 607.39 649.25 653.89 661.35 697.18 701.07 748.22 772.06 775.49 803.25 821.22 874.06 882.73 893.42 916.84 944.91 987.56 1024.45 1042.24 1082.57 1099.48 1117.23 1153.07 1183.82 1211.41 1223.09 1232.25 1275.71 1288.82 1309.73 1347.45 1356.66 1365.48 1373.33 1384.94 1445.92 1451.97 1473.72 1493.98 1544.62 1564.85 1567.77 1597.39 1602.32 1605.91 1610.40 1620.95 1653.05 1704.28 1710.90 1724.78 1728.36 1730.04 1740.26 1760.77 1785.75 1790.05 1814.77 1818.25 1842.15 1856.74 1864.57 1871.13 1885.22 1904.14 1925.31 1927.93 1934.15 1943.76 1964.67 2003.23 2038.72 2061.81 2076.17 2087.75 2089.13 2115.93 2155.12 2171.57 2175.05 2184.15 2186.70 2199.75 2217.43 2220.22 2233.07 2254.31 2256.58 2273.51 2275.84 2294.21 2335.35 2351.47 2356.14 2359.95 2360.80 2366.24 2372.15 2375.31 2383.77 2386.90 2388.71 2397.90 2422.30 2517.10 2532.42 2564.64 2609.24 2745.19 3732.81 4459.04 4479.66 4507.38 4528.62 4594.44 4598.33 4604.20 4619.11 4636.35 4657.19 4662.78 4668.62 4675.74 4687.74 4690.37 4740.00 4765.41 4768.73 4805.95 4841.18 4855.93 4865.05 4865.89 4876.08 4901.91 4905.60 4940.23 0.515602 0.544178 0.545122 0.452157 -1800.890895 -1800.862318 -1800.861374 -1800.954339 3.118061D-04 MUNgauss RevisionA2.1 retrievium 25-May-2021 DUDE CCN(CC)S(=O)(=O)c1ccc(c(c1)C(=O)[O-])N2CCN(CC2)Cc3ccc(cc3)C#N C13091639 RHF 6-31G(d) (6D,10F) C1 455.175302 |X|Y|Z| 148.666282 50.342992 33.541191 63.082659 19 6 7 17 2 |36.858105| |12.456939|36.858105| |7.521706|13.005346|53.358707| |5.920788|7.567272|17.763374|36.858105| |4.391102|5.681321|10.424998|12.487339|36.858105| |5.165744|7.017434|15.838440|7.143876|5.372203|388.023441| |3.902099|5.011977|10.521729|6.672431|5.796536|94.248253|73.516695| |4.834979|6.612629|10.513680|5.010811|4.226581|94.533208|13.633901|73.516695| |4.831333|5.248427|9.468656|5.512767|4.039128|76.808521|13.104417|12.991017|36.858105| |3.816220|4.010432|7.120615|4.905844|3.754332|49.496952|11.643679|8.910550|13.767716|36.858105| |3.371965|3.327421|5.418351|3.836427|3.045160|33.777406|7.896408|6.861943|8.015928|13.790631|36.858105| |3.484525|3.268082|4.982328|3.404971|2.715097|29.828419|6.539284|6.510571|6.851105|7.842121|13.632066|36.858105| |4.218601|3.850738|5.621546|3.591800|2.818944|33.593901|6.760258|7.690573|7.851981|6.757520|7.867670|13.545662|36.858105| |5.204978|5.057532|7.651520|4.440296|3.361776|49.709913|8.788264|11.141143|13.749791|7.937277|6.954339|7.968271|13.745158|36.858105| |3.984615|3.454430|4.660444|2.992631|2.429918|26.124188|5.343277|6.424091|5.014140|4.362215|4.885800|7.193235|12.237193|7.651051|36.858105| |4.815355|3.913185|4.967071|3.128418|2.528809|26.357728|5.262172|6.621924|4.685644|3.896870|4.074584|5.322624|8.180055|6.988003|15.486461|73.516695| |3.175321|2.830280|3.846929|2.532131|2.116799|21.739354|4.634964|5.401638|4.008943|3.712546|4.306693|6.224486|7.978373|5.418755|15.496909|15.216028|73.516695| |2.904486|2.683076|3.961662|2.785326|2.301536|22.756573|5.171162|5.140043|4.543225|5.135017|7.832470|13.479789|7.775056|5.155728|6.231482|8.210380|11.399904|53.358707| |2.502059|2.353228|3.420084|2.371427|2.016551|19.978310|4.590793|4.699106|3.779517|4.113103|5.581953|7.812182|5.986493|4.293043|5.509892|7.257453|11.740323|17.839902|36.858105| |2.226724|2.065258|2.939425|2.066766|1.785011|16.603954|3.844795|3.947910|2.971794|3.166175|4.019908|5.144128|4.387985|3.346900|4.535149|6.367814|10.085402|10.711968|12.562192|36.858105| |2.080135|1.933165|2.775980|2.001249|1.740908|15.440441|3.649207|3.607143|2.716737|2.983249|3.796636|4.494529|3.690876|2.937983|3.638995|5.384874|7.397824|9.152067|7.768345|13.019916|53.358707| |2.298021|2.108840|3.053155|2.239261|1.920553|16.692003|3.939839|3.809559|2.978338|3.334926|4.358927|5.126601|4.031076|3.188124|3.828122|5.741123|7.305552|10.745778|6.719587|7.927694|17.811829|36.858105| |2.603991|2.418449|3.603351|2.642463|2.218144|20.142748|4.757553|4.473884|3.795602|4.507816|6.620097|7.757215|5.167754|3.975431|4.364457|6.368911|7.872936|17.976508|7.970815|6.706760|10.568690|12.508132|36.858105| |1.860691|1.723849|2.440795|1.766765|1.558457|13.367496|3.169203|3.158667|2.274344|2.444302|2.962758|3.404094|2.973810|2.453692|3.049368|4.692707|6.190639|6.198083|5.081424|7.905683|17.960766|7.917986|5.076432|36.858105| |1.685197|1.576258|2.245075|1.648670|1.472396|12.228062|2.948016|2.872906|2.040918|2.220038|2.644747|2.889458|2.516201|2.144863|2.511266|3.960556|4.910906|4.981812|3.885072|5.075053|10.468915|6.196350|4.316741|12.548796|36.858105| |1.620373|1.537500|2.215305|1.633880|1.468659|12.191141|2.981484|2.851735|2.028324|2.244472|2.673289|2.824228|2.417677|2.090094|2.342991|3.689880|4.519682|4.767950|3.744218|4.510186|8.867773|5.415235|4.209754|7.530723|13.673342|36.858105| |1.478805|1.411412|2.033772|1.512531|1.375735|11.119972|2.747187|2.601200|1.814581|2.004393|2.330338|2.401744|2.087610|1.846165|2.016603|3.232743|3.826575|3.884374|2.972983|3.401213|6.064311|4.067693|3.383591|5.010693|7.902683|13.805597|36.858105| |1.405175|1.333896|1.906203|1.422377|1.299486|10.294922|2.535578|2.415712|1.660540|1.811238|2.074515|2.147996|1.903891|1.695923|1.865748|3.033716|3.524262|3.423758|2.575913|2.960691|5.108049|3.554158|2.934824|4.425432|6.833906|7.936021|13.680679|36.858105| |1.446078|1.358307|1.924194|1.431595|1.301690|10.311853|2.513811|2.427173|1.666445|1.797376|2.059879|2.174614|1.949335|1.723583|1.945665|3.176225|3.696715|3.497325|2.617612|3.100560|5.359350|3.747286|2.968432|5.006931|7.891940|6.871084|7.916463|13.721171|36.858105| |1.578490|1.470453|2.077211|1.534251|1.380444|11.157571|2.691803|2.628828|1.829105|1.966519|2.288280|2.476387|2.212009|1.918692|2.235607|3.608921|4.313651|4.106856|3.103802|3.877672|7.029812|4.730963|3.486489|7.539252|13.710081|7.956921|6.886032|7.948794|13.771157|36.858105| |1.287443|1.229432|1.756469|1.316848|1.215411|9.452155|2.344939|2.221062|1.502349|1.634051|1.839421|1.876998|1.681105|1.521317|1.642189|2.699197|3.070415|2.914432|2.175418|2.426027|3.998544|2.845068|2.459492|3.313877|4.501824|5.118472|7.749059|13.192082|7.765034|5.122540|36.858105| |1.205788|1.156072|1.650479|1.240542|1.153197|8.859827|2.207596|2.085141|1.394056|1.511692|1.681919|1.702897|1.536823|1.404815|1.499502|2.481796|2.786687|2.602364|1.934708|2.122493|3.410037|2.449859|2.170752|2.766592|3.548217|3.958211|5.450437|7.379928|5.460195|3.961025|16.750494|53.358707| |17.525809|8.892130|7.541673|4.592714|3.745675|29.560672|5.830201|7.382902|3.874083|3.159779|2.866507|3.003976|3.608527|4.248071|3.610611|7.927275|5.250535|3.520455|2.280177|2.067881|2.624937|2.105220|2.330141|1.750037|1.586712|1.518883|1.391245|1.330177|1.374314|1.497650|1.222510|1.562174|0.500000| |17.546872|8.739463|9.219392|6.405596|4.637028|32.651379|6.570413|7.210603|4.443979|3.736199|3.352791|3.409635|3.931859|4.591670|3.665908|7.613118|5.294929|3.932928|2.447288|2.200675|2.850674|2.354795|2.663435|1.878630|1.715098|1.647434|1.509257|1.439734|1.483572|1.615075|1.320875|1.684608|0.302484|0.500000| |17.604470|8.695315|9.010531|5.161634|3.810293|37.564449|6.895072|8.874237|5.569742|4.241916|3.832844|4.146295|5.377453|6.735469|5.146073|11.720811|6.885790|4.598309|2.874093|2.524780|3.155176|2.563054|2.930533|2.050446|1.829372|1.749019|1.579479|1.493791|1.542017|1.699596|1.357799|1.721917|0.302239|0.301383|0.500000| |8.853064|17.533062|12.589074|7.089764|6.230835|38.984799|7.858561|9.331610|4.143150|3.383807|2.860108|2.782750|3.168180|3.934976|2.902233|5.780460|4.350366|3.197990|2.082803|1.856264|2.390856|1.911858|2.162226|1.583623|1.462198|1.428959|1.322480|1.256409|1.278267|1.374405|1.165403|1.498102|0.217159|0.209251|0.172318|0.500000| |8.839856|17.672238|12.558717|5.626878|4.636798|49.809129|8.624893|14.550935|5.108278|3.806402|3.179067|3.171473|3.823890|5.116025|3.500280|7.075434|5.123025|3.550768|2.340329|2.047070|2.573877|2.029186|2.314341|1.688597|1.536978|1.500312|1.374862|1.296817|1.319575|1.430141|1.194991|1.529729|0.212962|0.172627|0.210148|0.304600|0.500000| |4.893958|5.675208|12.427218|17.622808|8.870424|50.239843|13.028958|8.352989|6.167364|6.057594|4.543178|3.804592|3.829712|4.639024|3.069126|5.521641|4.647315|4.174793|2.566474|2.208629|2.937287|2.440945|2.952299|1.882621|1.762621|1.759797|1.626141|1.518640|1.519947|1.628644|1.402474|1.794125|0.107658|0.147036|0.128348|0.142690|0.128041|0.500000| |6.803089|7.360924|12.544052|17.588675|8.840969|38.970196|8.732085|7.498301|4.803664|4.333601|3.614482|3.325510|3.527958|4.194769|3.026445|5.740312|4.533909|3.778621|2.340621|2.071527|2.745108|2.281849|2.656544|1.792573|1.671512|1.641366|1.519603|1.438996|1.458687|1.566361|1.330830|1.705147|0.144013|0.237031|0.156763|0.197736|0.146095|0.305332|0.500000| |4.529421|6.043003|9.427861|8.786985|17.545575|33.804720|8.524082|7.218529|3.577452|3.237030|2.695156|2.474364|2.619612|3.113764|2.321270|4.369106|3.601211|2.888562|1.880592|1.680840|2.220232|1.786193|2.031543|1.472794|1.388987|1.378477|1.292900|1.227357|1.234376|1.308950|1.149991|1.487642|0.111335|0.130644|0.105121|0.209356|0.137004|0.173227|0.209862|0.500000| |3.807387|4.985466|9.377517|8.845242|17.605805|40.491362|12.438388|7.961728|4.064165|3.819106|3.037484|2.664827|2.744919|3.292524|2.345319|4.276571|3.664852|3.065994|1.998284|1.756689|2.325644|1.866137|2.164068|1.525835|1.444165|1.450904|1.360759|1.279313|1.274301|1.348328|1.198587|1.549774|0.091616|0.107219|0.095178|0.145943|0.121329|0.212990|0.173563|0.300778|0.500000| |3.781939|4.468575|7.584306|8.825264|17.515791|30.378069|8.335784|6.124193|3.511588|3.421153|2.864304|2.545278|2.583007|2.974996|2.244322|4.122532|3.517318|2.994546|1.924084|1.720611|2.313821|1.887045|2.165211|1.529487|1.458268|1.457776|1.374371|1.302726|1.302784|1.374017|1.223672|1.584405|0.091522|0.115060|0.092750|0.134816|0.103605|0.212925|0.213714|0.301160|0.300011|0.500000| |3.430305|3.734312|6.834292|5.035821|4.028338|46.964450|13.499850|8.283035|8.906381|17.752459|8.897860|5.599256|4.894456|5.643626|3.502323|5.715336|5.468439|5.671402|3.481844|2.779124|3.654134|2.984006|3.914516|2.238207|2.077889|2.129467|1.931989|1.747449|1.717870|1.854206|1.593035|2.018552|0.079980|0.094782|0.101347|0.090501|0.097744|0.182199|0.118946|0.093710|0.117720|0.103156|0.500000| |2.893605|2.865428|4.620365|3.407981|2.808066|27.910420|6.935079|5.778865|5.693088|8.995663|17.733006|8.897668|5.613794|4.995405|3.984931|6.019610|6.578282|9.800908|5.369917|4.000849|5.442938|4.655410|7.382490|3.087563|2.825588|2.930626|2.558857|2.243660|2.194397|2.418976|1.985945|2.464703|0.069620|0.081288|0.088931|0.070268|0.075858|0.112829|0.089768|0.068884|0.078246|0.075098|0.216168|0.500000| |5.973473|5.744959|7.774806|4.254922|3.292436|47.337491|8.061681|12.365129|8.907510|5.647600|4.999802|5.683526|9.053418|17.787138|7.364643|14.079487|9.201579|5.700218|3.675097|3.002019|3.575289|2.804560|3.331663|2.251429|1.971794|1.908463|1.697767|1.574383|1.608238|1.785246|1.419792|1.791543|0.137994|0.135241|0.225989|0.120353|0.173063|0.116396|0.113165|0.087420|0.089011|0.079924|0.124064|0.108338|0.500000| |2.302242|2.215662|3.269609|2.285545|1.969868|19.421995|4.587777|4.550772|3.612392|4.083508|5.512381|6.615068|4.983081|3.878434|4.366193|6.069708|8.770226|12.322873|17.387899|8.869828|9.486691|5.875491|7.169361|4.695595|3.824902|3.916602|3.119009|2.631946|2.601007|3.017451|2.232842|2.706110|0.058273|0.062670|0.072147|0.054901|0.061315|0.069325|0.061879|0.050765|0.054826|0.052380|0.098862|0.157858|0.092180|0.500000| |2.608949|2.457776|3.524726|2.383029|2.024812|20.866687|4.690635|5.044119|3.948038|4.060841|5.175706|7.417293|6.707626|4.719398|6.617811|8.253181|15.516126|12.547609|17.731708|8.975490|7.695555|5.026360|5.752820|4.211208|3.285578|3.146537|2.576391|2.276636|2.325130|2.721989|1.954634|2.391043|0.066396|0.069494|0.084307|0.059946|0.069026|0.070627|0.065049|0.052854|0.055873|0.053089|0.094318|0.130074|0.114344|0.297638|0.500000| |2.021763|1.897658|2.689303|1.883479|1.649060|15.281780|3.565958|3.689471|2.667831|2.814498|3.446949|4.198763|3.733442|2.972316|3.900786|5.626576|8.706134|7.718095|8.905536|17.540026|12.488603|5.719083|5.009105|7.260474|4.874263|4.441050|3.373060|2.921438|3.030861|3.741414|2.405014|2.870331|0.052641|0.055149|0.063072|0.047686|0.052722|0.055569|0.052143|0.043335|0.045362|0.044132|0.069778|0.095807|0.075445|0.217022|0.213237|0.500000| |2.338859|2.127277|2.974239|2.078757|1.787016|16.522092|3.764086|3.960209|2.935969|3.030955|3.746721|4.928220|4.523761|3.407359|5.126090|7.189135|12.101442|9.653146|8.982751|17.501685|12.192279|7.000147|5.817532|7.032783|4.547985|3.865423|3.027588|2.737668|2.946903|3.706343|2.268387|2.719963|0.060788|0.064094|0.074376|0.053006|0.058581|0.060996|0.058504|0.047074|0.048470|0.047743|0.073400|0.100251|0.086612|0.174665|0.222519|0.299883|0.500000| |2.118235|1.958617|2.845480|2.123100|1.844903|15.408171|3.699777|3.501818|2.677360|3.025056|3.827422|4.184013|3.368914|2.787833|3.174586|4.924482|5.927789|7.739278|5.005607|5.705259|12.468614|17.550089|8.889379|7.249523|7.012405|6.304372|4.788997|4.170234|4.356333|5.417227|3.268273|3.772289|0.054102|0.060889|0.064503|0.049881|0.052090|0.064466|0.060212|0.047593|0.049794|0.050904|0.077354|0.117316|0.068781|0.131581|0.109998|0.127881|0.142387|0.500000| |2.426428|2.176783|3.098157|2.266462|1.932141|16.598095|3.855616|3.807980|2.939248|3.184816|4.031704|4.905166|4.107875|3.226071|4.113768|6.269706|7.819766|9.672574|5.840811|7.037264|12.284855|17.436995|8.906739|7.080350|5.389439|4.444429|3.512460|3.231360|3.542178|4.512048|2.631472|3.115734|0.062078|0.069431|0.075688|0.054773|0.057958|0.067777|0.065131|0.050272|0.051630|0.052681|0.078514|0.113899|0.080064|0.134389|0.131425|0.143064|0.205829|0.300409|0.500000| |2.813277|2.586239|3.889453|2.926158|2.420399|21.161077|5.006583|4.588713|3.970223|4.779141|6.816828|7.286577|5.061480|4.054821|4.188376|6.373077|7.143313|12.506428|5.723422|4.997513|7.673743|8.913463|17.578672|4.200412|3.752988|3.644882|3.070590|2.740376|2.784197|3.195805|2.342457|2.843946|0.069096|0.081737|0.087341|0.064301|0.067448|0.092067|0.082867|0.061071|0.064784|0.066188|0.116159|0.209647|0.094097|0.145035|0.128295|0.109676|0.130277|0.213725|0.218821|0.500000| |2.378374|2.266085|3.424443|2.528533|2.159429|19.503577|4.742878|4.323316|3.607605|4.453934|6.477599|6.511542|4.437988|3.613208|3.693571|5.487011|6.687137|12.208591|7.077795|5.837276|9.484524|8.902646|17.405052|4.700716|4.265418|4.497793|3.637016|3.045118|2.968361|3.390728|2.564082|3.081436|0.059271|0.067327|0.073145|0.056723|0.060527|0.079244|0.069459|0.054632|0.059288|0.058794|0.111716|0.230798|0.084405|0.212431|0.144036|0.131245|0.133604|0.218411|0.174412|0.300545|0.500000| |1.764722|1.645271|2.317998|1.662696|1.475776|12.785707|3.029020|3.059988|2.156053|2.289638|2.731568|3.136283|2.807043|2.336666|2.925443|4.503729|6.069104|5.527656|4.841589|7.628727|12.607338|5.738440|4.229359|17.538098|9.010031|6.482606|4.559161|4.038619|4.472354|6.251996|3.108112|3.576528|0.046388|0.049045|0.053982|0.042029|0.045155|0.048925|0.046623|0.038907|0.040319|0.040073|0.058354|0.078211|0.060163|0.126542|0.116298|0.235414|0.187861|0.144803|0.146947|0.098180|0.111768|0.500000| |1.908302|1.743988|2.441919|1.768022|1.555695|13.184482|3.098395|3.122560|2.229894|2.358788|2.821452|3.282807|2.950425|2.434304|3.119406|4.877289|6.321465|5.856448|4.548883|6.766238|12.259033|7.252388|4.679053|17.425356|8.892664|5.599109|4.190795|3.982403|4.771690|7.286705|3.071359|3.538995|0.050139|0.053719|0.058506|0.044556|0.047320|0.051951|0.050313|0.041033|0.042019|0.042435|0.059766|0.080119|0.062696|0.112066|0.109010|0.166278|0.197394|0.182884|0.216132|0.112847|0.114878|0.303478|0.500000| |1.681875|1.606837|2.333019|1.712166|1.534038|13.017200|3.192117|3.040163|2.190251|2.452199|2.965249|3.117175|2.615180|2.247827|2.490802|3.866912|4.821643|5.323778|4.322547|5.060368|9.907895|5.699723|4.696766|7.029680|8.944519|17.751811|8.927110|5.642079|4.953830|5.664862|4.150522|4.611014|0.043565|0.047256|0.050625|0.041288|0.043687|0.051508|0.047409|0.039840|0.042316|0.042119|0.064496|0.091555|0.056490|0.131894|0.098492|0.139929|0.114055|0.173681|0.123807|0.108638|0.147016|0.175887|0.141774|0.500000| |1.427854|1.375109|1.992606|1.485217|1.359312|10.952529|2.731719|2.559435|1.775870|1.973966|2.276413|2.301119|1.997123|1.786328|1.906115|3.061632|3.589794|3.646936|2.792026|3.076002|5.264782|3.580988|3.150364|4.085564|5.627980|8.924522|17.727851|8.904536|5.639079|4.959597|7.137989|7.463211|0.037265|0.040429|0.042186|0.035869|0.037248|0.044477|0.041209|0.035411|0.037536|0.037776|0.053411|0.070077|0.045582|0.083158|0.067712|0.085396|0.075687|0.114656|0.085774|0.079974|0.096642|0.106265|0.096318|0.214638|0.500000| |1.377201|1.291638|1.820078|1.356957|1.239945|9.683378|2.360038|2.285407|1.549008|1.657766|1.876128|1.975719|1.795411|1.601879|1.803798|2.979006|3.406366|3.122968|2.317004|2.704539|4.492991|3.211391|2.608686|4.084465|5.624331|4.951922|5.636040|8.912068|17.728958|8.908030|7.147116|7.475906|0.036538|0.039327|0.040597|0.033919|0.034831|0.039817|0.038540|0.032784|0.033646|0.034552|0.044142|0.055080|0.041809|0.063520|0.058054|0.073493|0.072877|0.101626|0.086831|0.069198|0.071805|0.103805|0.113395|0.107554|0.124064|0.500000| 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